Geometry & MOs

Info

ID:	24765
PubChem CID:	613196
Reduced:	NF2O3H17C18 (1)
Stoich.:	AB2C3D17E18 (1)
Weight, g/mol:	333.11765
ΔH_f, kcal/mol:	-191.5
Dipole, Da:	6.67
IP(EA), eV:	-8.98(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(2,5-difluorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C=CC(=C3)F)F)C(=O)OC

DOS

IR

Vibrations